sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate

C78H67Cl4K2N4NaO6Pt2 — CID 163670437

IUPACsodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate
SMILESCC(=O)[O-].CC1(C)c2ccccc2-c2cc(O)c(/C=N/c3ccccc3/N=C/c3cc4c(cc3O)-c3ccccc3C4(C)C)cc21.CC1(C)c2ccccc2-c2cc(O)c(/C=N/c3ccccc3/N=C/c3cc4c(cc3O)-c3ccccc3C4(C)C)cc21.Cl[Pt](Cl)(Cl)Cl.[K][K].[Na+].[Pt]
InChIInChI=1S/2C38H32N2O2.C2H4O2.4ClH.2K.Na.2Pt/c2*1-37(2)29-13-7-5-11-25(29)27-19-35(41)23(17-31(27)37)21-39-33-15-9-10-16-34(33)40-22-24-18-32-28(20-36(24)42)26-12-6-8-14-30(26)38(32,3)4;1-2(3)4;;;;;;;;;/h2*5-22,41-42H,1-4H3;1H3,(H,3,4);4*1H;;;;;/q;;;;;;;;;+1;;+4/p-5/b2*39-21+,40-22+;;;;;;;;;;
InChIKeyFSEZAPQDROPFHE-SNOSRVIMSA-I
MW1789.57 g/mol
LogP16.17
Rot. Bonds8

About sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate

sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate (PubChem CID 163670437) has the molecular formula C78H67Cl4K2N4NaO6Pt2 and a molecular weight of 1789.57 g/mol. Its IUPAC name is sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate.

Molecular Properties

Compound Namesodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate
PubChem CID163670437
Molecular FormulaC78H67Cl4K2N4NaO6Pt2
Molecular Weight1789.57 g/mol
Exact Mass1786.23
IUPAC Namesodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate
SMILESCC(=O)[O-].CC1(C)c2ccccc2-c2cc(O)c(/C=N/c3ccccc3/N=C/c3cc4c(cc3O)-c3ccccc3C4(C)C)cc21.CC1(C)c2ccccc2-c2cc(O)c(/C=N/c3ccccc3/N=C/c3cc4c(cc3O)-c3ccccc3C4(C)C)cc21.Cl[Pt](Cl)(Cl)Cl.[K][K].[Na+].[Pt]
InChIInChI=1S/2C38H32N2O2.C2H4O2.4ClH.2K.Na.2Pt/c2*1-37(2)29-13-7-5-11-25(29)27-19-35(41)23(17-31(27)37)21-39-33-15-9-10-16-34(33)40-22-24-18-32-28(20-36(24)42)26-12-6-8-14-30(26)38(32,3)4;1-2(3)4;;;;;;;;;/h2*5-22,41-42H,1-4H3;1H3,(H,3,4);4*1H;;;;;/q;;;;;;;;;+1;;+4/p-5/b2*39-21+,40-22+;;;;;;;;;;
InChIKeyFSEZAPQDROPFHE-SNOSRVIMSA-I
XLogP16.17
TPSA170.49 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms97
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001789.57
LogP ≤ 516.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate with MolForge

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Frequently Asked Questions

What is the IUPAC name of sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate?
The IUPAC name of sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate (CID 163670437) is sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate.
What is the SMILES notation for sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate?
The canonical SMILES for sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate is CC(=O)[O-].CC1(C)c2ccccc2-c2cc(O)c(/C=N/c3ccccc3/N=C/c3cc4c(cc3O)-c3ccccc3C4(C)C)cc21.CC1(C)c2ccccc2-c2cc(O)c(/C=N/c3ccccc3/N=C/c3cc4c(cc3O)-c3ccccc3C4(C)C)cc21.Cl[Pt](Cl)(Cl)Cl.[K][K].[Na+].[Pt].
What is the InChIKey of sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate?
The InChIKey is FSEZAPQDROPFHE-SNOSRVIMSA-I. The full InChI is InChI=1S/2C38H32N2O2.C2H4O2.4ClH.2K.Na.2Pt/c2*1-37(2)29-13-7-5-11-25(29)27-19-35(41)23(17-31(27)37)21-39-33-15-9-10-16-34(33)40-22-24-18-32-28(20-36(24)42)26-12-6-8-14-30(26)38(32,3)4;1-2(3)4;;;;;;;;;/h2*5-22,41-42H,1-4H3;1H3,(H,3,4);4*1H;;;;;/q;;;;;;;;;+1;;+4/p-5/b2*39-21+,40-22+;;;;;;;;;;.
What are the key properties of sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate?
sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate has a molecular weight of 1789.57 g/mol, XLogP of 16.17, 8 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;bis(2-[[2-[(3-hydroxy-9,9-dimethylfluoren-2-yl)methylideneamino]phenyl]iminomethyl]-9,9-dimethylfluoren-3-ol);platinum;potassiopotassium;tetrachloroplatinum;acetate is sourced from PubChem (CID 163670437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).